2-Biphenylacetonitrile

HCID 334101

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 19853-10-2
Standard SMILES: N#CCc1ccccc1-c1ccccc1
InChIKey: WVYPDPJNPRIPPW-UHFFFAOYSA-N
Molecular formula: C14H11N
Average molar mass: 193.24 g/mol
Monoisotopic mass: 193.08914935

Names & identifiers

Preferred name: 2-Biphenylacetonitrile
IUPAC: 2-(2-phenylphenyl)acetonitrile
English name: 2-Biphenylacetonitrile
Molecular formula: C14H11N
Molecular weight: 193.24

Names & synonyms

2-Biphenylacetonitrile19853-10-22-([1,1'-Biphenyl]-2-yl)acetonitrile[1,1'-Biphenyl]-2-acetonitrile2-(2-phenylphenyl)acetonitrileMFCD000602942-{[1,1'-biphenyl]-2-yl}acetonitrileBiphenylacetonitrileNSC3384552-Cyanomethylbiphenyl2-Biphenylylacetonitrile2-phenylphenylacetonitrile

Show more names

2-biphenylethylnitrile

2-(biphenyl-2-yl)acetonitrileSCHEMBL1343377DTXSID00319003[1,1'-Biphenyl]-2-ylacetonitrileAKOS006230025([1,1'-Biphenyl]-2-yl)acetonitrile[1,1'-Biphenyl]-2-ylacetonitrile #2-[1,1'-Biphenyl]-2-ylacetonitrile

Database identifiers

CAS: 19853-10-2
PubChem CID: 334101
DTXSID: DTXSID00319003
EC Number: 673-542-4
Nikkaji: J1.538.789K

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 23.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 231

Physicochemical properties

Boiling point: 122 °C · 122°C 1mm
Density: 1 · 1,07 g/cm3
storage temp.: Sealed in dry,Room Temperature
Appearance: Colorless to light yellow Liquid
CAS DataBase Reference: 19853 · 19853-10-2(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
Hazard Codes: Xi,T
HazardClass: IRRITANT, TOXIC
HS Code: 2926907090 · 2926907090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.